1,4-bis(2-phenylethyl)piperidine

C21H27N — CID 86059939

IUPAC1,4-bis(2-phenylethyl)piperidine
SMILESc1ccc(CCC2CCN(CCc3ccccc3)CC2)cc1
InChIInChI=1S/C21H27N/c1-3-7-19(8-4-1)11-12-21-14-17-22(18-15-21)16-13-20-9-5-2-6-10-20/h1-10,21H,11-18H2
InChIKeyRLHMJCDNUGNMFM-UHFFFAOYSA-N
MW293.45 g/mol
LogP4.57
Rot. Bonds6

About 1,4-bis(2-phenylethyl)piperidine

1,4-bis(2-phenylethyl)piperidine (PubChem CID 86059939) has the molecular formula C21H27N and a molecular weight of 293.45 g/mol. Its IUPAC name is 1,4-bis(2-phenylethyl)piperidine.

Molecular Properties

Compound Name1,4-bis(2-phenylethyl)piperidine
PubChem CID86059939
Molecular FormulaC21H27N
Molecular Weight293.45 g/mol
Exact Mass293.21
IUPAC Name1,4-bis(2-phenylethyl)piperidine
SMILESc1ccc(CCC2CCN(CCc3ccccc3)CC2)cc1
InChIInChI=1S/C21H27N/c1-3-7-19(8-4-1)11-12-21-14-17-22(18-15-21)16-13-20-9-5-2-6-10-20/h1-10,21H,11-18H2
InChIKeyRLHMJCDNUGNMFM-UHFFFAOYSA-N
XLogP4.57
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.45
LogP ≤ 54.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

4-(3-phenylpropyl)-1-[4-[4-(3-phenylpropyl)piperidin-1-yl]butyl]piperidine;dihydrochloride
CID 70096793
4-(2-benzhydryloxyethyl)-1-(2-phenylethyl)piperidine
CID 10046504
hypochlorous acid;1-(2-phenylethyl)piperidin-4-amine
CID 159010718
4-phenyl-1-(2-phenylethyl)piperidine
CID 54327803
1-[1-(2-phenylethyl)piperidin-4-yl]propan-2-one
CID 91066531
1-(2-phenylethyl)pyrrolidin-3-amine
CID 18411819
1-(2-phenylethyl)-4-propan-2-ylpiperidine
CID 18683008
1-[2-(3-methoxyphenyl)ethyl]-4-[2-(4-methoxyphenyl)ethyl]piperidine;hydrochloride
CID 127043453
2-phenylethylcyclooctane
CID 54073487
4-(2-phenylethyl)-1-sulfanylazepane
CID 123467007
N,1-bis(2-phenylethyl)piperidin-4-amine
CID 24785666
4-(chloromethyl)-1-(3-phenylpropyl)piperidine
CID 55183322

Frequently Asked Questions

What is the IUPAC name of 1,4-bis(2-phenylethyl)piperidine?
The IUPAC name of 1,4-bis(2-phenylethyl)piperidine (CID 86059939) is 1,4-bis(2-phenylethyl)piperidine.
What is the SMILES notation for 1,4-bis(2-phenylethyl)piperidine?
The canonical SMILES for 1,4-bis(2-phenylethyl)piperidine is c1ccc(CCC2CCN(CCc3ccccc3)CC2)cc1.
What is the InChIKey of 1,4-bis(2-phenylethyl)piperidine?
The InChIKey is RLHMJCDNUGNMFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H27N/c1-3-7-19(8-4-1)11-12-21-14-17-22(18-15-21)16-13-20-9-5-2-6-10-20/h1-10,21H,11-18H2.
What are the key properties of 1,4-bis(2-phenylethyl)piperidine?
1,4-bis(2-phenylethyl)piperidine has a molecular weight of 293.45 g/mol, XLogP of 4.57, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4-bis(2-phenylethyl)piperidine is sourced from PubChem (CID 86059939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).